SCHEMBL8771501

SCHEMBL8771501

CCCCC(c1ccc(N)cc1)c1ccc(CC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.43
MAPT P10636 2/20 0.43
HTR2A P28223 3/20 0.41
TSHR P16473 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
MAOB P27338 3/20 0.37
HRH1 P35367 1/20 0.37
BDKRB2 P30411 1/20 0.37
CYP3A4 P08684 2/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
PDE4D Q08499 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
CNR1 P21554 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8771576 0.95 HTR2A (0.44) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8771510 0.93 HTR2A (0.46) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8771618 0.93 HTR2A (0.46) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8771496 0.93 HTR2A (0.46) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8771524 0.93 HTR2A (0.46) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8771422 0.93 HTR2A (0.46) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL12112001 0.91 CYP19A1 (0.47) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8101640 0.91 CYP19A1 (0.47) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL7930221 0.89 CYP3A4 (0.50) CYP19A1MAPTHTR2ATSHRTDP1
SCHEMBL8095645 0.89 CYP3A4 (0.50) CYP19A1MAPTHTR2ATSHRTDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799270-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-10-08 EP disclosed
WO-1997014742-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-04-24 WO disclosed